3,3-dimethyl-1-piperidin-4-ylpiperidine;dihydrochloride

C12H26Cl2N2 — CID 156735226

IUPAC3,3-dimethyl-1-piperidin-4-ylpiperidine;dihydrochloride
SMILESCC1(C)CCCN(C2CCNCC2)C1.Cl.Cl
InChIInChI=1S/C12H24N2.2ClH/c1-12(2)6-3-9-14(10-12)11-4-7-13-8-5-11;;/h11,13H,3-10H2,1-2H3;2*1H
InChIKeyBLDGVQKEDRQJIL-UHFFFAOYSA-N
MW269.26 g/mol
LogP2.70
Rot. Bonds1

About 3,3-dimethyl-1-piperidin-4-ylpiperidine;dihydrochloride

3,3-dimethyl-1-piperidin-4-ylpiperidine;dihydrochloride (PubChem CID 156735226) has the molecular formula C12H26Cl2N2 and a molecular weight of 269.26 g/mol. Its IUPAC name is 3,3-dimethyl-1-piperidin-4-ylpiperidine;dihydrochloride.

Molecular Properties

Compound Name3,3-dimethyl-1-piperidin-4-ylpiperidine;dihydrochloride
PubChem CID156735226
Molecular FormulaC12H26Cl2N2
Molecular Weight269.26 g/mol
Exact Mass268.15
IUPAC Name3,3-dimethyl-1-piperidin-4-ylpiperidine;dihydrochloride
SMILESCC1(C)CCCN(C2CCNCC2)C1.Cl.Cl
InChIInChI=1S/C12H24N2.2ClH/c1-12(2)6-3-9-14(10-12)11-4-7-13-8-5-11;;/h11,13H,3-10H2,1-2H3;2*1H
InChIKeyBLDGVQKEDRQJIL-UHFFFAOYSA-N
XLogP2.70
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.26
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-1-piperidin-4-ylpiperidine;dihydrochloride?
The IUPAC name of 3,3-dimethyl-1-piperidin-4-ylpiperidine;dihydrochloride (CID 156735226) is 3,3-dimethyl-1-piperidin-4-ylpiperidine;dihydrochloride.
What is the SMILES notation for 3,3-dimethyl-1-piperidin-4-ylpiperidine;dihydrochloride?
The canonical SMILES for 3,3-dimethyl-1-piperidin-4-ylpiperidine;dihydrochloride is CC1(C)CCCN(C2CCNCC2)C1.Cl.Cl.
What is the InChIKey of 3,3-dimethyl-1-piperidin-4-ylpiperidine;dihydrochloride?
The InChIKey is BLDGVQKEDRQJIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2.2ClH/c1-12(2)6-3-9-14(10-12)11-4-7-13-8-5-11;;/h11,13H,3-10H2,1-2H3;2*1H.
What are the key properties of 3,3-dimethyl-1-piperidin-4-ylpiperidine;dihydrochloride?
3,3-dimethyl-1-piperidin-4-ylpiperidine;dihydrochloride has a molecular weight of 269.26 g/mol, XLogP of 2.70, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-1-piperidin-4-ylpiperidine;dihydrochloride is sourced from PubChem (CID 156735226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).